1-Butanol → HCID 21934608, compound

HRID 117340

Reaction equation

[CH2:32]([OH:33])[CH2:34][CH2:35][CH3:36].[CH:9]([N:10]([CH:11]([CH3:12])[CH3:13])[CH2:14][CH3:15])([CH3:16])[CH3:17].[Cl:1][c:2]1[cH:3][c:4]([NH2:8])[n:5][cH:6][n:7]1.[N:18]1([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:19][CH2:20][NH:21][CH2:22][CH2:23][CH2:24]1>>[c:2]1([N:21]2[CH2:20][CH2:19][N:18]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:24][CH2:23][CH2:22]2)[cH:3][c:4]([NH2:8])[n:5][cH:6][n:7]1

Participants

Reactant 4

HCID 2631-Butanol

HCID 81531Diisopropylethylamine

HCID 2380124-Amino-6-chloropyrimidine

HCID 2756058Tert-butyl 1,4-diazepane-1-carboxylate

Product 1

HCID 21934608HCID 21934608, compound

Sources & evidence

ORD record: ord-afdb85de349740d99f8cef156807cad8
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

Loading…